methyl 4-[(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)methyl]benzoate

Systemtic Name: methyl 4-[(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)methyl]benzoate Openeye Name: methyl 4-[[5-(2-thienyl)tetrazol-2-yl]methyl]benzoate CAS Name: 4-[(5-thiophen-2-yl-2-tetrazolyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-thiophen-2-yltetrazol-2-yl)methyl]benzoate Traditional Name: 4-[[5-(2-thienyl)tetrazol-2-yl]methyl]benzoic acid methyl ester Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2N=C(N=N2)C3=CC=CS3

InChI

InChI=1S/C14H12N4O2S/c1-20-14(19)11-6-4-10(5-7-11)9-18-16-13(15-17-18)12-3-2-8-21-12/h2-8H,9H2,1H3